(2S)-N-(6-methoxypyridin-3-yl)-1-(4-methylphenyl)sulfonyl-pyrrolidine-2-carboxamide

Systemtic Name: (2S)-N-(6-methoxypyridin-3-yl)-1-(4-methylphenyl)sulfonyl-pyrrolidine-2-carboxamide Openeye Name: (2S)-N-(6-methoxy-3-pyridyl)-1-(p-tolylsulfonyl)pyrrolidine-2-carboxamide CAS Name: (2S)-N-(6-methoxy-3-pyridinyl)-1-(4-methylphenyl)sulfonyl-2-pyrrolidinecarboxamide IUPAC Name: (2S)-N-(6-methoxypyridin-3-yl)-1-(4-methylphenyl)sulfonylpyrrolidine-2-carboxamide Traditional Name: (2S)-N-(6-methoxy-3-pyridyl)-1-tosyl-pyrrolidine-2-carboxamide Formula: C18H21N3O4S MolecularWeight: 375.44204

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CCCC2C(=O)NC3=CN=C(C=C3)OC

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CCC[C@H]2C(=O)NC3=CN=C(C=C3)OC

InChI

InChI=1S/C18H21N3O4S/c1-13-5-8-15(9-6-13)26(23,24)21-11-3-4-16(21)18(22)20-14-7-10-17(25-2)19-12-14/h5-10,12,16H,3-4,11H2,1-2H3,(H,20,22)/t16-/m0/s1